N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromanyl-4-methoxy-phenyl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromanyl-4-methoxy-phenyl)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxy-phenyl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxyphenyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-bromo-4-methoxyphenyl)propanamide Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-N-piperonyl-propionamide Formula: C18H18BrNO4 MolecularWeight: 392.24382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C18H18BrNO4/c1-22-15-5-2-12(8-14(15)19)4-7-18(21)20-10-13-3-6-16-17(9-13)24-11-23-16/h2-3,5-6,8-9H,4,7,10-11H2,1H3,(H,20,21)